| SpectraBase Compound ID | EvKsM1prqAI |
|---|---|
| InChI | InChI=1S/C28H38O5/c1-17(29)21-12-14-28(32)22-10-9-19-15-20(30)11-13-26(19,2)23(22)16-24(27(21,28)3)33-25(31)18-7-5-4-6-8-18/h4-9,17,20-24,29-30,32H,10-16H2,1-3H3/t17?,20-,21+,22+,23-,24+,26-,27-,28-/m0/s1 |
| InChIKey | RYISHMXWTYFBGL-JHTQYCRHSA-N |
| Mol Weight | 454.6 g/mol |
| Molecular Formula | C28H38O5 |
| Exact Mass | 454.271924 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68aYQGM3Vxa |
|---|---|
| Name | 12-O-BENZOYL-BOUCERIN |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H38O5 |
| InChI | InChI=1S/C28H38O5/c1-17(29)21-12-14-28(32)22-10-9-19-15-20(30)11-13-26(19,2)23(22)16-24(27(21,28)3)33-25(31)18-7-5-4-6-8-18/h4-9,17,20-24,29-30,32H,10-16H2,1-3H3/t17?,20-,21+,22+,23-,24+,26-,27-,28-/m0/s1 |
| InChIKey | RYISHMXWTYFBGL-JHTQYCRHSA-N |
| Literature Reference Author | K.HAYASHI,I.IIDA,Y.NAKAO,Y.NAKAO,K.KANEKO |
| Literature Reference Citation | PHYTOCHEM.,27,3919(1988) |
| Literature Reference DOI | 10.1016/0031-9422(88)83045-0 |
| Molecular Weight | 454.607 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK1116 |